ethyl 1,2-dimethyl-5-[3-(2-methylbenzimidazol-1-yl)-2-oxidanyl-propoxy]indole-3-carboxylate

Systemtic Name: ethyl 1,2-dimethyl-5-[3-(2-methylbenzimidazol-1-yl)-2-oxidanyl-propoxy]indole-3-carboxylate Openeye Name: ethyl 5-[2-hydroxy-3-(2-methylbenzimidazol-1-yl)propoxy]-1,2-dimethyl-indole-3-carboxylate CAS Name: 5-[2-hydroxy-3-(2-methyl-1-benzimidazolyl)propoxy]-1,2-dimethyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-hydroxy-3-(2-methylbenzimidazol-1-yl)propoxy]-1,2-dimethylindole-3-carboxylate Traditional Name: 5-[2-hydroxy-3-(2-methylbenzimidazol-1-yl)propoxy]-1,2-dimethyl-indole-3-carboxylic acid ethyl ester Formula: C24H27N3O4 MolecularWeight: 421.48888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CN3C(=NC4=CC=CC=C43)C)O)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CN3C(=NC4=CC=CC=C43)C)O)C)C

InChI

InChI=1S/C24H27N3O4/c1-5-30-24(29)23-15(2)26(4)21-11-10-18(12-19(21)23)31-14-17(28)13-27-16(3)25-20-8-6-7-9-22(20)27/h6-12,17,28H,5,13-14H2,1-4H3